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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-44359
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Ta', 'V', 'O']
  • Chemical System: O-Ta-V
  • Density: 7.313355168615414
  • Atomic Density: 0.08930853449887294
  • Unit Cell Volume: 134.3656579668927
  • Molar Volume: 6.743074213222028
  • Full Formula: Ta2 V2 O8
  • Reduced Formula: TaVO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 109
  • Spacegroup Symbol: I4_1md
  • Crystal System: tetragonal
  • Pointgroup: 4mm